Acetone → 3-Bromo-5-{6-[2-(2-ethoxycarbonyl-ethyl)-3-(3-ethoxycarbonyl-propoxy)-phenyl]-hexyloxy}-benzoic Acid tert-butyl Ester
Reaction equation
[C:30]([CH3:31])([CH3:32])([CH3:33])[O:34][C:35]([c:36]1[cH:37][c:38]([Br:43])[cH:39][c:40]([OH:42])[cH:41]1)=[O:44].[C:45](=[O:46])([O-:47])[O-:48].[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][CH2:7][O:8][c:9]1[c:10]([CH2:22][CH2:23][C:24](=[O:25])[O:26][CH2:27][CH3:28])[c:11]([CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][Br:21])[cH:12][cH:13][cH:14]1)=[O:29].[CH3:51][N:52]([CH3:53])[CH:54]=[O:55].[CH3:56][C:57](=[O:58])[CH3:59].[ClH:61].[K+:49].[K+:50].[OH2:60]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][CH2:7][O:8][c:9]1[c:10]([CH2:22][CH2:23][C:24](=[O:25])[O:26][CH2:27][CH3:28])[c:11]([CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][O:42][c:40]2[cH:39][c:38]([Br:43])[cH:37][c:36]([C:35]([O:34][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:44])[cH:41]2)[cH:12][cH:13][cH:14]1)=[O:29]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-3eb17db37ce54d1b9be213bd2b434a29
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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